Molmodel

units.h

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00001 #ifndef SimTK_MOLMODEL_UNITS_H_
00002 #define SimTK_MOLMODEL_UNITS_H_
00003 
00004 /* -------------------------------------------------------------------------- *
00005  *                      SimTK Core: SimTK Molmodel                            *
00006  * -------------------------------------------------------------------------- *
00007  * This is part of the SimTK Core biosimulation toolkit originating from      *
00008  * Simbios, the NIH National Center for Physics-Based Simulation of           *
00009  * Biological Structures at Stanford, funded under the NIH Roadmap for        *
00010  * Medical Research, grant U54 GM072970. See https://simtk.org.               *
00011  *                                                                            *
00012  * Portions copyright (c) 2008 Stanford University and the Authors.           *
00013  * Authors: Christopher Bruns                                                 *
00014  * Contributors:                                                              *
00015  *                                                                            *
00016  * Permission is hereby granted, free of charge, to any person obtaining a    *
00017  * copy of this software and associated documentation files (the "Software"), *
00018  * to deal in the Software without restriction, including without limitation  *
00019  * the rights to use, copy, modify, merge, publish, distribute, sublicense,   *
00020  * and/or sell copies of the Software, and to permit persons to whom the      *
00021  * Software is furnished to do so, subject to the following conditions:       *
00022  *                                                                            *
00023  * The above copyright notice and this permission notice shall be included in *
00024  * all copies or substantial portions of the Software.                        *
00025  *                                                                            *
00026  * THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR *
00027  * IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,   *
00028  * FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL    *
00029  * THE AUTHORS, CONTRIBUTORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM,    *
00030  * DAMAGES OR OTHER LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR      *
00031  * OTHERWISE, ARISING FROM, OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE  *
00032  * USE OR OTHER DEALINGS IN THE SOFTWARE.                                     *
00033  * -------------------------------------------------------------------------- */
00034 
00035 #include "molmodel/internal/common.h"
00036 #include "SimTKcommon.h"
00037 
00038 namespace SimTK {
00039 
00040 // These typedefs are a documentation tool for method signatures
00041 
00042 // Angles are not specific to small scales, so are not in the mdunits namespace
00043 
00047 typedef Real Angle; // in radians
00048 
00049 typedef Real LineAngle; // angle in range (0,Pi)
00050 typedef Real CircleAngle; // angle in range (-Pi,Pi) or in range (0,2Pi)
00051 typedef Real WindingAngle; // angle in range (-infinity, +infinity)
00052 
00053 namespace mdunits {
00057 typedef Real Length; // in nanometers
00058 
00062 typedef Real Mass; // in atomic mass units
00063 
00064 typedef Real Energy; // in kilojoules per mole
00065 
00066 typedef Real Charge; // in elementary charge units
00067 
00068 } // namespace mdunits
00069 
00070 
00071 static const Real Deg2Rad = (Real)SimTK_DEGREE_TO_RADIAN;
00072 static const Real Rad2Deg = (Real)SimTK_RADIAN_TO_DEGREE;
00073 
00074 }
00075 
00076 #endif // SimTK_MOLMODEL_UNITS_H_
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